2,2-dimethyl-5-[[(2-sulfanylphenyl)amino]methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[[(2-sulfanylphenyl)amino]methylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[(2-sulfanylanilino)methylene]-1,3-dioxane-4,6-dione CAS Name: 5-[(2-mercaptoanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(2-sulfanylanilino)methylidene]-1,3-dioxane-4,6-dione Traditional Name: 5-[(2-mercaptoanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=CC=CC=C2S)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=CC=CC=C2S)C(=O)O1)C

InChI

InChI=1S/C13H13NO4S/c1-13(2)17-11(15)8(12(16)18-13)7-14-9-5-3-4-6-10(9)19/h3-7,14,19H,1-2H3